iterations/neb2_max2_image02_iter6_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422569913017E+04 0.42257E+04 -0.25383E+05 8992 0.103E+03
DAV: 2 -0.102583717925E+03 -0.43283E+04 -0.39252E+04 10992 0.248E+02
DAV: 3 -0.425534404492E+03 -0.32295E+03 -0.30235E+03 10216 0.657E+01
DAV: 4 -0.434193245038E+03 -0.86588E+01 -0.85340E+01 10872 0.108E+01
DAV: 5 -0.434491710858E+03 -0.29847E+00 -0.29760E+00 11256 0.195E+00 0.992E+01
RMM: 6 -0.382726786759E+03 0.51765E+02 -0.11129E+02 9678 0.146E+01 0.708E+01
RMM: 7 -0.731486586695E+03 -0.34876E+03 -0.36333E+02 11038 0.187E+01 0.146E+02
RMM: 8 -0.495650592908E+03 0.23584E+03 -0.10196E+02 10059 0.107E+01 0.903E+01
RMM: 9 -0.420283564676E+03 0.75367E+02 -0.67849E+01 10237 0.106E+01 0.575E+01
RMM: 10 -0.371165350868E+03 0.49118E+02 -0.31919E+01 10211 0.738E+00 0.207E+01
RMM: 11 -0.380329895527E+03 -0.91645E+01 -0.11201E+01 10378 0.364E+00 0.336E+01
RMM: 12 -0.373251385860E+03 0.70785E+01 -0.41159E+00 9903 0.282E+00 0.159E+01
RMM: 13 -0.374934172351E+03 -0.16828E+01 -0.81508E-01 10026 0.128E+00 0.111E+01
RMM: 14 -0.378711130228E+03 -0.37770E+01 -0.87790E-01 10346 0.122E+00 0.119E+01
RMM: 15 -0.386155617714E+03 -0.74445E+01 -0.19261E+00 11490 0.172E+00 0.124E+01
RMM: 16 -0.388075283771E+03 -0.19197E+01 -0.11898E+00 10862 0.131E+00 0.736E+00
RMM: 17 -0.391730446018E+03 -0.36552E+01 -0.49055E-01 10385 0.852E-01 0.621E+00
RMM: 18 -0.394656968034E+03 -0.29265E+01 -0.53277E-01 10980 0.833E-01 0.612E+00
RMM: 19 -0.398343821229E+03 -0.36869E+01 -0.13465E+00 12099 0.118E+00 0.602E+00
RMM: 20 -0.401805608311E+03 -0.34618E+01 -0.10072E+00 11900 0.101E+00 0.556E+00
RMM: 21 -0.406136966041E+03 -0.43314E+01 -0.16166E+00 12679 0.118E+00 0.548E+00
RMM: 22 -0.409781998268E+03 -0.36450E+01 -0.18141E+00 12821 0.117E+00 0.552E+00
RMM: 23 -0.411425009959E+03 -0.16430E+01 -0.46632E-01 11532 0.620E-01 0.567E+00
RMM: 24 -0.411921370920E+03 -0.49636E+00 -0.15961E-01 10926 0.379E-01 0.596E+00
RMM: 25 -0.412261339504E+03 -0.33997E+00 -0.52569E-02 10550 0.220E-01 0.609E+00
RMM: 26 -0.412399436729E+03 -0.13810E+00 -0.11533E-02 10889 0.951E-02 0.607E+00
RMM: 27 -0.412100542341E+03 0.29889E+00 -0.31382E-02 11085 0.218E-01 0.600E+00
RMM: 28 -0.411449138012E+03 0.65140E+00 -0.18311E-01 14194 0.524E-01 0.536E+00
RMM: 29 -0.411034567874E+03 0.41457E+00 -0.15796E-01 14261 0.486E-01 0.594E+00
RMM: 30 -0.410633669270E+03 0.40090E+00 -0.33639E-02 11567 0.228E-01 0.650E+00
RMM: 31 -0.411301587817E+03 -0.66792E+00 -0.81212E-02 12756 0.354E-01 0.557E+00
RMM: 32 -0.412128198644E+03 -0.82661E+00 -0.61102E-01 16140 0.805E-01 0.635E+00
RMM: 33 -0.412956984207E+03 -0.82879E+00 -0.32034E-01 15288 0.589E-01 0.443E+00
RMM: 34 -0.413178917695E+03 -0.22193E+00 -0.10112E-01 13464 0.402E-01 0.396E+00
RMM: 35 -0.413243786288E+03 -0.64869E-01 -0.61909E-03 10342 0.107E-01 0.383E+00
RMM: 36 -0.413625622808E+03 -0.38184E+00 -0.13612E-02 11123 0.167E-01 0.345E+00
RMM: 37 -0.414445790274E+03 -0.82017E+00 -0.41107E-02 12909 0.268E-01 0.256E+00
RMM: 38 -0.414793753921E+03 -0.34796E+00 -0.14490E-02 11086 0.152E-01 0.198E+00
RMM: 39 -0.415063624282E+03 -0.26987E+00 -0.11893E-02 10951 0.130E-01 0.187E+00
RMM: 40 -0.415173347417E+03 -0.10972E+00 -0.10521E-02 11145 0.116E-01 0.164E+00
RMM: 41 -0.415272742265E+03 -0.99395E-01 -0.89969E-03 11151 0.106E-01 0.119E+00
RMM: 42 -0.415404815650E+03 -0.13207E+00 -0.68892E-03 11008 0.902E-02 0.960E-01
RMM: 43 -0.415509984762E+03 -0.10517E+00 -0.89802E-03 11585 0.951E-02 0.729E-01
RMM: 44 -0.415635288295E+03 -0.12530E+00 -0.16833E-02 12522 0.118E-01 0.506E-01
RMM: 45 -0.415712519861E+03 -0.77232E-01 -0.10650E-02 11982 0.956E-02 0.471E-01
RMM: 46 -0.415755856478E+03 -0.43337E-01 -0.70007E-03 11546 0.762E-02 0.444E-01
RMM: 47 -0.415808457208E+03 -0.52601E-01 -0.45587E-03 11280 0.620E-02 0.391E-01
RMM: 48 -0.415876196705E+03 -0.67739E-01 -0.40682E-03 11424 0.549E-02 0.328E-01
RMM: 49 -0.415929619352E+03 -0.53423E-01 -0.21761E-03 11098 0.406E-02 0.272E-01
RMM: 50 -0.415970169589E+03 -0.40550E-01 -0.12369E-03 10993 0.312E-02 0.201E-01
RMM: 51 -0.415999134158E+03 -0.28965E-01 -0.23385E-03 12106 0.423E-02 0.114E-01
RMM: 52 -0.416047141527E+03 -0.48007E-01 -0.96545E-04 11293 0.290E-02 0.106E-01
RMM: 53 -0.416080867771E+03 -0.33726E-01 -0.42567E-04 10805 0.197E-02 0.770E-02
RMM: 54 -0.416090193953E+03 -0.93262E-02 -0.14941E-04 9748 0.119E-02 0.482E-02
RMM: 55 -0.416093259848E+03 -0.30659E-02 -0.10023E-04 9460 0.960E-03 0.544E-02
RMM: 56 -0.416091625347E+03 0.16345E-02 -0.41022E-05 7982 0.696E-03 0.281E-02
RMM: 57 -0.416093116591E+03 -0.14912E-02 -0.22780E-05 7293 0.551E-03 0.208E-02
RMM: 58 -0.416093807927E+03 -0.69134E-03 -0.19293E-05 7164 0.411E-03 0.158E-02
RMM: 59 -0.416094112744E+03 -0.30482E-03 -0.92483E-06 6644 0.291E-03 0.130E-02
RMM: 60 -0.416094644694E+03 -0.53195E-03 -0.92582E-06 6727 0.265E-03 0.883E-03
RMM: 61 -0.416095036331E+03 -0.39164E-03 -0.55132E-06 6385 0.199E-03 0.780E-03
RMM: 62 -0.416095208367E+03 -0.17204E-03 -0.26800E-06 4797 0.145E-03 0.840E-03
RMM: 63 -0.416095321364E+03 -0.11300E-03 -0.16440E-06 4289 0.124E-03 0.490E-03
RMM: 64 -0.416095409654E+03 -0.88291E-04 -0.19075E-06 5087 0.131E-03 0.304E-03
RMM: 65 -0.416095452496E+03 -0.42842E-04 -0.70559E-07 3142 0.877E-04 0.165E-03
RMM: 66 -0.416095478540E+03 -0.26044E-04 -0.81811E-07 3723 0.104E-03 0.111E-02
RMM: 67 -0.416095482479E+03 -0.39385E-05 -0.27362E-07 2846 0.900E-04
1 F= -.45382006E+03 E0= -.45381959E+03 d E =-.139238E-02 mag= -0.0007